1-[3,4-bis(oxidanyl)phenyl]-2-[(4-dimethylaminophenyl)methylsulfanyl]ethanone

Systemtic Name: 1-[3,4-bis(oxidanyl)phenyl]-2-[(4-dimethylaminophenyl)methylsulfanyl]ethanone Openeye Name: 1-(3,4-dihydroxyphenyl)-2-[(4-dimethylaminophenyl)methylsulfanyl]ethanone CAS Name: 1-(3,4-dihydroxyphenyl)-2-[(4-dimethylaminophenyl)methylthio]ethanone IUPAC Name: 1-(3,4-dihydroxyphenyl)-2-[(4-dimethylaminophenyl)methylsulfanyl]ethanone Traditional Name: 1-(3,4-dihydroxyphenyl)-2-[[4-(dimethylamino)benzyl]thio]ethanone Formula: C17H19NO3S MolecularWeight: 317.40266

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CSCC(=O)C2=CC(=C(C=C2)O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CSCC(=O)C2=CC(=C(C=C2)O)O

InChI

InChI=1S/C17H19NO3S/c1-18(2)14-6-3-12(4-7-14)10-22-11-17(21)13-5-8-15(19)16(20)9-13/h3-9,19-20H,10-11H2,1-2H3